2,6-Epoxy-2H-naphthaceno[1,2-b]oxocin-9,16-dione,4-(dimethylamino)-3,4,5,6,11,12,13,14-octahydro-3,5,8,10,13-pentahydroxy-6,13-dimethyl-,(2R,3S,4R,5R,6R,13S)- (9CI)

Modify Date: 2025-09-29 09:11:07

2,6-Epoxy-2H-naphthaceno[1,2-b]oxocin-9,16-dione,4-(dimethylamino)-3,4,5,6,11,12,13,14-octahydro-3,5,8,10,13-pentahydroxy-6,13-dimethyl-,(2R,3S,4R,5R,6R,13S)- (9CI) Structure
2,6-Epoxy-2H-naphthaceno[1,2-b]oxocin-9,16-dione,4-(dimethylamino)-3,4,5,6,11,12,13,14-octahydro-3,5,8,10,13-pentahydroxy-6,13-dimethyl-,(2R,3S,4R,5R,6R,13S)- (9CI) structure
Common Name 2,6-Epoxy-2H-naphthaceno[1,2-b]oxocin-9,16-dione,4-(dimethylamino)-3,4,5,6,11,12,13,14-octahydro-3,5,8,10,13-pentahydroxy-6,13-dimethyl-,(2R,3S,4R,5R,6R,13S)- (9CI)
CAS Number 71582-53-1 Molecular Weight 511.52000
Density 1.61g/cm3 Boiling Point 834.1ºC at 760 mmHg
Molecular Formula C27H29NO9 Melting Point N/A
MSDS N/A Flash Point 458.2ºC

 Names

Name 7-Deoxynogarol
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.61g/cm3
Boiling Point 834.1ºC at 760 mmHg
Molecular Formula C27H29NO9
Molecular Weight 511.52000
Flash Point 458.2ºC
Exact Mass 511.18400
PSA 156.99000
LogP 0.72880
Index of Refraction 1.739
InChIKey OTDXULFSLVOPKT-UHFFFAOYSA-N
SMILES CN(C)C1C(O)C2Oc3c(cc(O)c4c3C(=O)c3cc5c(c(O)c3C4=O)CCC(C)(O)C5)C(C)(O2)C1O

 Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
KD1146600
CHEMICAL NAME :
2,6-Epoxy-2H-naphthaceno(1,2-b)oxocin-9,16-dione, 3,4,5,6,11,12,13,14-octahydro-4- (dimethylamino)-3,5,8,10,13-pentahydroxy-6,13-dimethy l-, (2-alpha,3-beta,4-alpha,5-beta, 6-alpha,13-alpha)-
CAS REGISTRY NUMBER :
71582-53-1
LAST UPDATED :
198403
DATA ITEMS CITED :
3
MOLECULAR FORMULA :
C27-H29-N-O9
MOLECULAR WEIGHT :
511.57

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

MUTATION DATA

TYPE OF TEST :
Mutation test systems - not otherwise specified
TEST SYSTEM :
Mammal - species unspecified Lymphocyte
DOSE/DURATION :
12 umol/L
REFERENCE :
CBINA8 Chemico-Biological Interactions. (Elsevier Scientific Pub. Ireland Ltd., POB 85, Limerick, Ireland) V.1- 1969- Volume(issue)/page/year: 36,1,1981

 Synonyms

nogarol,7-deoxy
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