(Q115971466)

English

(1S,2S,4S,9R,12S,13R,17S,18S,19S)-19-hydroxy-1,2,13,17-tetramethyl-7-(4-methylpent-3-enyl)-5-oxapentacyclo[10.8.0.02,9.04,8.013,18]icosa-7,14-diene-6,16,20-trione

chemical compound

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Statements

instance of

type of chemical entity

0 references

subclass of

fusidane triterpenoid

1 reference

based on heuristic

inferred from SMILES

mass

466.271924316 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₂₉H₃₈O₅

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canonical SMILES

O=C1OC2C(=C1CCC=C(C)C)C3CCC4C5(C=CC(=O)C(C)C5C(O)C(=O)C4(C)C3(C)C2)C

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isomeric SMILES

CC(C)=CCCC1=C2[C@H](C[C@@]3(C)[C@H]2CC[C@H]2[C@@]4(C)C=CC(=O)[C@@H](C)[C@@H]4[C@H](O)C(=O)[C@@]23C)OC1=O

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found in taxon

Aspergillus fumigatus

1 reference

stated in

Helvolic Acid Derivatives with Antibacterial Activities against Streptococcus agalactiae from the Marine-Derived Fungus Aspergillus fumigatus HNMF0047

Identifiers

InChI

InChI=1S/C29H38O5/c1-15(2)8-7-9-17-22-18-10-11-21-27(4)13-12-19(30)16(3)23(27)24(31)25(32)29(21,6)28(18,5)14-20(22)34-26(17)33/h8,12-13,16,18,20-21,23-24,31H,7,9-11,14H2,1-6H3/t16-,18+,20+,21+,23-,24+,27-,28+,29-/m1/s1

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InChIKey

CZLFAMRWSRZRHF-IDTZKTCDSA-N

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2 references

3 January 2023

inferred from InChIKey

matched by identifier from

InChIKey

CZLFAMRWSRZRHF-IDTZKTCDSA-N

1 reference

(Q115971466)

(1S,2S,4S,9R,12S,13R,17S,18S,19S)-19-hydroxy-1,2,13,17-tetramethyl-7-(4-methylpent-3-enyl)-5-oxapentacyclo[10.8.0.02,9.04,8.013,18]icosa-7,14-diene-6,16,20-trione

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Identifiers

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