(9R,14S,17S,23R,24S)-23,24-dihydroxy-5-methoxy-12,12-dimethyl-9-(2-methylprop-1-en-1-yl)-10,11-dioxa-8,15,21-triazahexacyclo[12.10.1.0²,⁷.0⁸,²⁵.0¹⁵,²³.0¹⁷,²¹]pentacosa-1(25),2,4,6-tetraene-16,22-dione



Compound number:
MolPort-003-959-926
CAS number: 12771-72-1
IUPAC:
(9R,14S,17S,23R,24S)-23,24-dihydroxy-5-methoxy-12,12-dimethyl-9-(2-methylprop-1-en-1-yl)-10,11-dioxa-8,15,21-triazahexacyclo[12.10.1.0²,⁷.0⁸,²⁵.0¹⁵,²³.0¹⁷,²¹]pentacosa-1(25),2,4,6-tetraene-16,22-dione
IUPAC traditional:
(9R,14S,17S,23R,24S)-23,24-dihydroxy-5-methoxy-12,12-dimethyl-9-(2-methylprop-1-en-1-yl)-10,11-dioxa-8,15,21-triazahexacyclo[12.10.1.0²,⁷.0⁸,²⁵.0¹⁵,²³.0¹⁷,²¹]pentacosa-1(25),2,4,6-tetraene-16,22-dione
SMILES:
[#6]-[#8]-c1ccc2c3-[#6@H](-[#8])[C@]4([#8])[#7](-[#6@H]-5-[#6]C([#6])([#6])[#8]-[#8]-[#6@H](\[#6]=[#6](\[#6])-[#6])-n(c3-5)c2c1)-[#6](=O)-[#6@@H]-1-[#6]-[#6]-[#6]-[#7]-1-[#6]4=O
InChI key:
LRXYHMMJJCTUMY-GWXUGYLUSA-N
Molecular formula:
C27H33N3O7
Molecular weight: 511.575
Solubility: not available

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Supplier Catalogue Data


Catalog: Screening compound Ships out: 20 business days Purity: >=95%
Last updated: last month In warehouse: Unverified
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1 mg December 31, 2020 113.74 USD
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5 mg December 31, 2020 341.22 USD
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S&H to USA: 35.00 USD
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Supplier Catalogue Data


Catalog: Building blocks Ships out: 8 business days Purity: ≥95%
Last updated: 3 months ago In warehouse: Unverified
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1 mg December 15, 2020 120.00 USD
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5 mg December 15, 2020 286.00 USD
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S&H to USA: 80.00 USD
S&H to World: 100.00 USD

Supplier Catalogue Data


Catalog: Building blocks Ships out: 7 business days Purity: 95%
Last updated: last month In warehouse: 35.00 mg
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1 mg December 14, 2020 146.00 USD
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5 mg December 14, 2020 546.00 USD
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More Information

Compound Identifiers
Compound number: MolPort-003-959-926
CAS number: 12771-72-1

Names, Synonyms and 3rd Party Identifiers
Name: ZINC000085564414
(5R,10S,10aR)-1,10,10a,14,14aS,15bS-hexahydro-10,10a-dihydroxy-7-methoxy-2,2-dimethyl-5-(2-methyl-1-propen-1-yl)-5H,12H-3,4-dioxa-5a,11a,15a-triazacyclooct[lm]indeno[5,6-b]fluorene-11,15(2H,13H)-dione
Verruculogen

InChI
InChI: 1S/C27H33N3O7/c1-14(2)11-20-29-18-12-15(35-5)8-9-16(18)21-22(29)19(13-26(3,4)37-36-20)30-24(32)17-7-6-10-28(17)25(33)27(30,34)23(21)31/h8-9,11-12,17,19-20,23,31,34H,6-7,10,13H2,1-5H3/t17-,19-,20+,23-,27+/m0/s1
InChI key: LRXYHMMJJCTUMY-GWXUGYLUSA-N

Calculated Properties
Molecular formula: C27H33N3O7
Molecular weight: 511.575

Other

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2020 MolPort, v4.05, release date 28-11-2020 20:00 (+0200). All rights reserved.
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