aurasperone A

CHEBI:133760 ·resolve ·ANTIPROTOZOAL ·EXACT SEEDED

A dimeric naphthopyran with formula C32H26O10, originally isolated from Aspergillus niger. — ChEBI

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

Strictly broader compounds or drug classes this molecule belongs to.

CHEBI:25807 CHEBI:25807
CHEBI:26195 CHEBI:26195
CHEBI:35618 CHEBI:35618
CHEBI:3992 CHEBI:3992
CHEBI:64459 CHEBI:64459
CHEBI:64542 CHEBI:64542
CHEBI:76224 CHEBI:76224

Chemical structure

Computed structure properties
Molecular formula	C32H26O10
Charge	0
Average mass	570.55 Da
Monoisotopic mass	570.1526 Da
Source	ChEBI
InChIKey	QAHRSPAZSGMZMT-UHFFFAOYSA-N

SMILES

COc1cc(OC)c2c(O)c3c(=O)cc(C)oc3c(-c3c(OC)cc4cc5oc(C)cc(=O)c5c(O)c4c3OC)c2c1

InChI

InChI=1S/C32H26O10/c1-13-7-18(33)26-22(41-13)10-15-9-20(38-4)28(31(40-6)23(15)29(26)35)25-17-11-16(37-3)12-21(39-5)24(17)30(36)27-19(34)8-14(2)42-32(25)27/h7-12,35-36H,1-6H3

Also called

5,5'-dihydroxy-6,6',8,8'-tetramethoxy-2,2'-dimethyl-4H,4'H-[7,10'-bibenzo[g]chromene]-4,4'-dione (EXACT_SYNONYM)— chebi
5,5'-dihydroxy-6,6',8,8'-tetramethoxy-2,2'-dimethyl-4H,4'H-[7,10'-binaphtho[2,3-b]pyran]-4,4'-dione (EXACT_SYNONYM)— chebi
Aurasperone (EXACT_SYNONYM)— chebi

Cross-references

Equivalent identifiers for this same structure in other resources.

cas:15085-74-2
chemspider:2341316
foodb.food:FDB012130
hmdb:HMDB0033929
knapsack:C00034441
reaxys:1445869

Activity roles

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

CHEBI:33281 CHEBI:33281
CHEBI:38068 CHEBI:38068

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:133760`	aurasperone A	`antibioticmech:chebi-a42739ed23`	2026-08-30

Curation history

SEEDED_FROM_SOURCES 2026-08-30 · seed_from_sources
Seeded from data/raw/ inventories (CHEBI)
RESEEDED_FROM_SOURCES 2026-08-30 · seed_from_sources
Re-seeded from updated data/raw/ inventories
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.