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(Q77420092)
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Atacamycin A
bioactive natural product
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Statements
instance of
type of chemical entity
0 references
subclass of
22-But-1-enyl-14,15-dihydroxy-10,16-dimethoxy-5,9,13-trimethyl-1-oxacyclodocosa-3,5,7,11,17,19-hexaen-2-one
1 reference
based on heuristic
inferred from SMILES
mass
500.313789128
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₃₀H₄₄O₆
0 references
canonical SMILES
O=C1OC(C=CCC)CC=CC=CC(OC)C(O)C(O)C(C=CC(OC)C(C=CC=C(C=C1)C)C)C
0 references
isomeric SMILES
CC/C=C/C1C/C=C/C=C\C(OC)C(O)C(O)C(C)/C=C/C(OC)C(C)/C=C/C=C(C)/C=C/C(=O)O1
1 reference
based on heuristic
inferred from InChI
found in taxon
Streptomyces
1 reference
stated in
Atacamycins A-C, 22-membered antitumor macrolactones produced by Streptomyces sp. C38.
Identifiers
InChI
InChI=1S/C30H44O6/c1-7-8-15-25-16-10-9-11-17-27(35-6)30(33)29(32)24(4)19-20-26(34-5)23(3)14-12-13-22(2)18-21-28(31)36-25/h8-15,17-21,23-27,29-30,32-33H,7,16H2,1-6H3/b10-9+,14-12+,15-8+,17-11-,20-19+,21-18+,22-13+
0 references
InChIKey
OGIODIOJAWTXMG-IPSJHBJRSA-N
2 references
stated in
PubChem
PubChem CID
56834469
language of work or name
English
stated in
Natural Product Atlas
PubChem CID
56834469
language of work or name
English
PubChem CID
56834469
2 references
stated in
PubChem
PubChem CID
56834469
language of work or name
English
matched by identifier from
InChIKey
InChIKey
OGIODIOJAWTXMG-IPSJHBJRSA-N
ChEBI ID
204790
mapping relation type
exact match
1 reference
matched by identifier from
International Chemical Identifier
InChI
InChI=1S/C30H44O6/c1-7-8-15-25-16-10-9-11-17-27(35-6)30(33)29(32)24(4)19-20-26(34-5)23(3)14-12-13-22(2)18-21-28(31)36-25/h8-15,17-21,23-27,29-30,32-33H,7,16H2,1-6H3/b10-9+,14-12+,15-8+,17-11-,20-19+,21-18+,22-13+
UniChem compound ID
33641187
1 reference
stated in
UniChem
Natural Product Atlas ID
NPA007956
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
OGIODIOJAWTXMG-IPSJHBJRSA-N
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