AntibioticMech

cervimycin B

antibioticmech:aro-ec60046a85 ·ANTIBACTERIAL ·MINTED SEEDED

Cervimycins are polyketide antibiotics. — PMID:36173303

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

polyketide with antibiotic activityARO:3005171

Strictly broader compounds or drug classes this molecule belongs to.

Chemical structure

Computed structure properties
Molecular formulaC61H80O25
Charge0
Average mass1213.3 Da
Monoisotopic mass1212.49886803 Da
SourcePubChem · retrieved 2026-08-29
InChIKeyBWIAPPHQSUHPDB-IWCGXAMISA-N

SMILES

C[C@@H]1[C@H](CC[C@@H](O1)O[C@H]2CC[C@@H](O[C@@H]2C)O[C@]34[C@H](CC5=CC6=C(C(=O)C=C(C6=O)OC)C(=C5C3=O)O)[C@H](C(=O)C(=C4O)C(=O)C)O[C@H]7CC[C@@H]([C@H](O7)C)O[C@H]8CC[C@@H]([C@@H](O8)C)O[C@H]9CC[C@@H]([C@@H](O9)C)O[C@H]1CC[C@@H]([C@@H](O1)C)OC(=O)C(C)C(=O)O)O

InChI

InChI=1S/C61H80O25/c1-25(59(70)71)60(72)84-42-14-19-47(77-32(42)8)82-39-12-17-45(75-29(39)5)81-38-11-18-46(76-28(38)4)83-40-13-20-48(78-30(40)6)85-56-35-23-33-22-34-52(37(64)24-43(73-9)53(34)65)54(66)51(33)58(69)61(35,57(68)50(26(2)62)55(56)67)86-49-21-15-41(31(7)79-49)80-44-16-10-36(63)27(3)74-44/h22,24-25,27-32,35-36,38-42,44-49,56,63,66,68H,10-21,23H2,1-9H3,(H,70,71)/t25?,27-,28+,29+,30-,31-,32+,35-,36+,38+,39+,40+,41+,42+,44+,45+,46+,47+,48+,49+,56-,61+/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:3007602 cervimycin B antibioticmech:aro-ec60046a85 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.