AntibioticMech

cyclomarin B

antibioticmech:aro-0f5084fe9f ·ANTIBACTERIAL ·MINTED SEEDED

Cyclomarin B is a cyclomarin antibiotic. — PMID:27241518

Machine-generated and unreviewed. Identity, structure and cross-references come straight from ChEBI's and CARD's own data; no curator has signed off on this record yet.

Classification

cyclomarin antibioticsARO:3007540

Strictly broader compounds or drug classes this molecule belongs to.

Chemical structure

Computed structure properties
Molecular formulaC56H82N8O10
Charge0
Average mass1027.3 Da
Monoisotopic mass1026.61539084 Da
SourcePubChem · retrieved 2026-08-29
InChIKeyHSTKEHHVGUSTOW-PMBWZYFTSA-N

SMILES

C[C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)N([C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N([C@H](C(=O)N1)CC(C)C)C)[C@@H](C2=CN(C3=CC=CC=C32)C(C)(C)[C@@H]4CO4)O)[C@H](C)C=C(C)C)CC(C)C)C)C(C)C)[C@@H](C5=CC=CC=C5)OC

InChI

InChI=1S/C56H82N8O10/c1-30(2)25-34(9)44-52(69)60-45(47(65)38-28-64(56(11,12)42-29-74-42)39-24-20-19-23-37(38)39)55(72)63(14)40(26-31(3)4)50(67)57-35(10)49(66)61-46(48(73-15)36-21-17-16-18-22-36)53(70)58-43(33(7)8)54(71)62(13)41(27-32(5)6)51(68)59-44/h16-25,28,31-35,40-48,65H,26-27,29H2,1-15H3,(H,57,67)(H,58,70)(H,59,68)(H,60,69)(H,61,66)/t34-,35+,40+,41+,42+,43+,44+,45+,46+,47-,48-/m1/s1

Cross-references

Equivalent identifiers for this same structure in other resources.

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
SourceNative IDLabelMinted CURIEVersion
ARO ARO:3007542 cyclomarin B antibioticmech:aro-0f5084fe9f 2026-08-30

Curation history

  1. SEEDED_FROM_SOURCES 2026-08-30 · seed_from_sources

    Seeded from data/raw/ inventories (ARO)

  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.