AntibioticMech

sclerodol B

CHEBI:141365 ·resolve ·ANTIFUNGAL ·EXACT SEEDED

A 3β-hydroxy steroid that is (3β,5α)-4,4,14-trimethylandrost-8-en-3-ol which is substituted by a (3E,6S)-2-methoxy-2-methylhept-3-en-6-yl group at position 17. — ChEBI

Classification

Strictly broader compounds or drug classes this molecule belongs to.

• CHEBI:25698 CHEBI:25698
• CHEBI:26893 CHEBI:26893
• CHEBI:36836 CHEBI:36836

Chemical structure

Computed structure properties

Molecular formula	C31H52O2
Charge	0
Average mass	456.755 Da
Monoisotopic mass	456.39673 Da
Source	ChEBI
InChIKey	KMUGSJNEBPVLKO-PWUQRKGSSA-N

SMILES

[H][C@@]12CCC3=C(CC[C@@]4(C)[C@@]3(C)CC[C@]4([H])[C@H](C)C/C=C/C(C)(C)OC)[C@@]1(C)CC[C@H](O)C2(C)C

InChI

InChI=1S/C31H52O2/c1-21(11-10-17-27(2,3)33-9)22-14-19-31(8)24-12-13-25-28(4,5)26(32)16-18-29(25,6)23(24)15-20-30(22,31)7/h10,17,21-22,25-26,32H,11-16,18-20H2,1-9H3/b17-10+/t21-,22-,25+,26+,29-,30-,31+/m1/s1

Also called

• (3β,23E)-25-methoxylanosta-8,23-dien-3-ol (EXACT_SYNONYM)— chebi

Cross-references

Equivalent identifiers for this same structure in other resources.

• reaxys:29689270

Activity roles

Every antimicrobial role a source asserts for this compound — the unreduced evidence behind its antimicrobial_class.

• CHEBI:35718 CHEBI:35718

Source concepts

Every upstream concept that resolved to this record. The merge is the product: this is what shows ChEBI and CARD are describing the same structure.

Upstream concepts merged into this record

Source	Native ID	Label	Minted CURIE	Version
CHEBI	CHEBI:141365	sclerodol B	antibioticmech:chebi-5c61f9d514	2026-08-30

Curation history

1. SEEDED_FROM_SOURCES 2026-08-30 · seed_from_sources

   Seeded from data/raw/ inventories (CHEBI)

2. RESEEDED_FROM_SOURCES 2026-08-30 · seed_from_sources

   Re-seeded from updated data/raw/ inventories

3. RESEEDED_FROM_SOURCES 2026-08-30 · seed_from_sources

   Re-seeded from updated data/raw/ inventories

Provenance

Seeded by scripts/seed_from_sources.py from the committed inventories in data/raw/. View the record.