General Information of Drug (ID: DMHPZ8I)

Drug Name
NSC-631570
Synonyms UKRAIN
Indication
Disease Entry ICD 11 Status REF
Solid tumour/cancer 2A00-2F9Z Approved [1]
Structure
3D MOL 2D MOL
Chemical Identifiers
Formula
C66H74N6O16PS+3
Canonical SMILES
C[N+]1(CC2=C(C=CC3=C2OCO3)C4C1C5=CC6=C(C=C5CC4O)OCO6)CCNP(=S)(NCC[N+]7(CC8=C(C=CC9=C8OCO9)C1C7C2=CC3=C(C=C2CC1O)OCO3)C)NCC[N+]1(CC2=C(C=CC3=C2OCO3)C2C1C1=CC3=C(C=C1CC2O)OCO3)C.O
InChI
1S/C66H72N6O15PS.H2O/c1-70(25-43-37(4-7-49-64(43)85-31-76-49)58-46(73)16-34-19-52-55(82-28-79-52)22-40(34)61(58)70)13-10-67-88(89,68-11-14-71(2)26-44-38(5-8-50-65(44)86-32-77-50)59-47(74)17-35-20-53-56(83-29-80-53)23-41(35)62(59)71)69-12-15-72(3)27-45-39(6-9-51-66(45)87-33-78-51)60-48(75)18-36-21-54-57(84-30-81-54)24-42(36)63(60)72;/h4-9,19-24,46-48,58-63,73-75H,10-18,25-33H2,1-3H3,(H3,67,68,69,89);1H2/q+3;/t46-,47-,48+,58?,59?,60?,61?,62?,63?,70?,71?,72?,88?;/m0./s1
InChIKey
FPORNMFLKJTCFO-GIBOVVLPSA-N
Cross-matching ID
PubChem CID
11969872
TTD ID
D06NNU

References

1 Drugs@FDA. U.S. Food and Drug Administration. U.S. Department of Health & Human Services. 2015