ID: 62665
SMILES:C(CCCC)c1cc(O)c(C2C(C(=C)C)CCC(C)=C2)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.427
InChIKey:QHMBSVQNZZTUGM-UHFFFAOYSA-N
ID: 62666
SMILES:CC(=CC(OCc1cc(O)c(C2C=C(C)CCC2C(C)=C)c(O)c1)(O)CCC)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 400.559
CB1 binding score: -15.512
InChIKey:WYPQHTPJQMNANN-UHFFFAOYSA-N
ID: 62667
SMILES:C(CCCc1cc2c(c(O)c1CC=C(C)C)CC(O)C(C)(C)O2)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -16.138
InChIKey:YSANSGPVBWINEC-UHFFFAOYSA-N
ID: 62668
SMILES:C(CCCCCCCCc1cc(-c2cc(CC=C)ccc2O)c(O)c2c1OC1C(C(C)(C)O2)CCC(C)=C1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 532.765
CB1 binding score: -15.329
InChIKey:WRAWINNCYXQBTB-UHFFFAOYSA-N
ID: 62669
SMILES:C(C)CCc1cc2c(c(O)c1)C1C(O)C(C)(O2)CCC1C(O)(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 334.456
CB1 binding score: -15.496
InChIKey:RJQNOPSSOIOOPU-UHFFFAOYSA-N
ID: 62670
SMILES:C=C(C)C1C2CC3=C4C(CC(=O)C(O3)C2(C)CC1)C(=O)C(c1c(O)cc(CCCC)cc1O)O4
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 466.574
CB1 binding score: -12.639
InChIKey:CRIFRBDLRAAAKG-UHFFFAOYSA-N
ID: 62671
SMILES:CC(C(=O)c1c2c(c(O)cc1)C1C=C(CO)CCC1C(C)(C)O2)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.424
CB1 binding score: -14.607
InChIKey:CTHLOWOWULVEPU-UHFFFAOYSA-N
ID: 62672
SMILES:N(C)(C)CCOc1cc(CCCC)cc(O)c1C1C(C(C)C)CCC(C)C1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 375.597
CB1 binding score: -15.411
InChIKey:UZBANNUCARJLBS-UHFFFAOYSA-N
ID: 62673
SMILES:c1(O)cc(C(O)=O)cc2c1OC(C)(C)C1C3c4ccc(O)cc4OC12C1C(CC2(C)C(C)C(=O)CC=C21)O3
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 518.562
CB1 binding score: Not available
InChIKey:SHHQDVZBAMMYKR-UHFFFAOYSA-N
ID: 62674
SMILES:Oc1c2c(cc(CCCCC)c1)OC(C)(C)C1=C2CC(C)C2C1C(CC=C(C)C)(C)C(=O)C2=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 464.646
CB1 binding score: -15.032
InChIKey:NDZMGEQOKZGFCM-UHFFFAOYSA-N
ID: 62675
SMILES:C1=C(C)CCC=C(C)CCC(C(=CC=CC(C)C)C)C1c1c(O)cc(CCCCC)cc1OC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 464.734
CB1 binding score: -16.303
InChIKey:ZPRGSQLGZQMLSP-UHFFFAOYSA-N
ID: 62676
SMILES:C1=C(C)CCC(C(C)C)C1c1c(O)cc(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -19.815
InChIKey:PCXRACLQFPRCBB-UHFFFAOYSA-N
ID: 62677
SMILES:Oc1c2c(cc(C(C(C)C)O)c1)OC(C)(C)C1C2=CC2=C(C1O)CCCC2C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 384.516
CB1 binding score: -18.271
InChIKey:GYVXEAOFHSRZDG-UHFFFAOYSA-N
ID: 62678
SMILES:Oc1cc(CCCCC)cc2c1C1C=C(C(OC)=O)C(O1)CC2C(=C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.462
CB1 binding score: -15.048
InChIKey:CBYCXPYDVMGRLN-UHFFFAOYSA-N
ID: 62679
SMILES:C1=Cc2c(cc(CCCCC)cc2O)OC1(C)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 246.35
CB1 binding score: -20.081
InChIKey:XLSYFQOJMWXOCT-UHFFFAOYSA-N
ID: 62680
SMILES:C(Cc1cc(C2C=C(C)CCC2C(=C)C)c(CC=C(C)CCC=C(C)CCC=C(C)C)c(O)c1)C=C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 514.838
CB1 binding score: -15.86
InChIKey:OQEMAABHVWFYLP-UHFFFAOYSA-N
ID: 62681
SMILES:CC1=CC(c2ccc(CCCCC)cc2)C(C(O)(C)C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.486
CB1 binding score: -18.046
InChIKey:MXECOWWPQRFPTG-UHFFFAOYSA-N
ID: 62682
SMILES:CC12CCC(C(=C)C)C(c3c(O)cc(CCCCC)cc3O1)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.441
CB1 binding score: -17.078
InChIKey:YZQTVMSDGCKDQL-UHFFFAOYSA-N
ID: 62683
SMILES:c1(-c2c(O)cc(C(C)C)cc2O)c(CCCC(C)C)cc(O)c2c1C(C(CCC=C(C)C)C)CCC(C)(C)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 536.797
CB1 binding score: -14.498
InChIKey:FJVIZCMKNVWHRS-UHFFFAOYSA-N
ID: 62684
SMILES:CC12Oc3c(c(O)cc(CCCCC)c3)C3C1CC(C(C)=C)CC23
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 326.48
CB1 binding score: -13.263
InChIKey:LGKKOGZZRBTGTG-UHFFFAOYSA-N
ID: 62685
SMILES:O(c1c2c(cc(CCCCC)c1)OC(C)(C)c1c-2cc(C)cc1)C1=C(C)C(=O)OC1(O)C=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 448.559
CB1 binding score: -14.793
InChIKey:NPUUESCFJZGBGU-UHFFFAOYSA-N