(-)-trans-anti-N2-BPDE-dG


CAS No. : 85026-87-5

(-)-trans-anti-N2-BPDE-dG,85026-87-5
Product Details
Cat No:R063221
Synonyms:[7S-(7α,8β,9β,10α)]-2’-Deoxy-N-(7,8,9,10-tetrahydro-7,8,9-trihydroxybenzo[a]pyren-10-yl)guanosine; Benzo[a]pyrene, guanosine deriv.; (-)-trans-anti-7,8,9-Trihydroxy-10-(2’-deoxyguanosin-2-yl)benzo[a]pyrene
Molecular Formula:C30H27N5O7
Molecular Weight:569.574
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Cat No:R063221
Cas No:85026-87-5
Product-Name:(-)-trans-anti-N2-BPDE-dG
IUPAC Name:9-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-2-[[(7S,8R,9S,10R)-7,8,9-trihydroxy-7,8,9,10-tetrahydrobenzo[a]pyren-10-yl]amino]-3H-purin-6-one
InChI:InChI=1S/C30H27N5O7/c36-10-18-17(37)9-19(42-18)35-11-31-24-28(35)33-30(34-29(24)41)32-23-22-15-7-6-13-3-1-2-12-4-5-14(21(15)20(12)13)8-16(22)25(38)27(40)26(23)39/h1-8,11,17-19,23,25-27,36-40H,9-10H2,(H2,32,33,34,41)/t17-,18+,19+,23+,25-,26-,27+/m0/s1
InChIKey:WOKFWJGVLJVTLH-CGTNIKCPSA-N
SMILES:C1C(C(OC1N2C=NC3=C2NC(=NC3=O)NC4C(C(C(C5=C4C6=C7C(=C5)C=CC8=C7C(=CC=C8)C=C6)O)O)O)CO)O
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