ID: 93094
SMILES:Cc1ccc(C)cc1Oc1c(O)cc(CCCCC)cc1OC1C(C)(C)C2CCC(C=O)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 462.63
CB1 binding score: -13.584
InChIKey:QPKXPYVXOGORNE-UHFFFAOYSA-N
ID: 93095
SMILES:c12c(cc(CCCCC)cc1O)OC(C)(C)C1C2C=C(CO)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -19.121
InChIKey:YCBKSSAWEUDACY-UHFFFAOYSA-N
ID: 93096
SMILES:CC(O)(C)C1C(c2c(O)cc(CCCCCCl)cc2O)C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 366.929
CB1 binding score: -14.214
InChIKey:IMMSVTJEPXCVNH-UHFFFAOYSA-N
ID: 93097
SMILES:C(Cc1cc(O)c2c(c1)OC(C)(C)C1CCC(=C)C12)(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -15.679
InChIKey:BOVPIHBKOWNFJR-UHFFFAOYSA-N
ID: 93098
SMILES:c1c2c(cc(O)c1CC=C(CCC=C(C)C)C)C(C)(C)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -16.464
InChIKey:GXVYSPWHESCEMY-UHFFFAOYSA-N
ID: 93099
SMILES:COc1c(CCCC)cc(O)c(CC=C(CCC=C(C)C)C)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -17.542
InChIKey:QFJIITCPNJABHD-UHFFFAOYSA-N
ID: 93100
SMILES:C1C(OCCO)C2(C(C)(C)C=CC(=O)C23OC3)C2c3c(O)cc(CCCC)cc3OC(C)(C)C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 470.606
CB1 binding score: -15.111
InChIKey:WBLUSDNLXFQVIX-UHFFFAOYSA-N
ID: 93101
SMILES:c1(C(CC(O)=O)O)cc2c(c(O)c1)C1CC(C)(O2)CCC1C(C)(OC)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 364.438
CB1 binding score: -16.989
InChIKey:XVGNHOVMWBLQNW-UHFFFAOYSA-N
ID: 93102
SMILES:Oc1cc(CCC)cc2c1C1C(CC=C(C)C1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -19.805
InChIKey:CDBDULHNWQRYSY-UHFFFAOYSA-N
ID: 93103
SMILES:C(CCCC)C(C)(CC)OC(=O)c1cc(OC)c2c(c1)OC(C)(C)C1OC(=O)C(O)C21
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 434.529
CB1 binding score: -14.987
InChIKey:JOKUDYLZECLXJO-UHFFFAOYSA-N
ID: 93104
SMILES:Oc1cc(CCCC)cc2c1C13C(C(C)(C)O1)CC(O)C2(O)CO3
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 334.412
CB1 binding score: -11.994
InChIKey:VVIQNPSHUPJBAB-UHFFFAOYSA-N
ID: 93105
SMILES:c1(CCCCC)c(OC)c2c(c(O)c1C(C(CC)C)=O)OC(C)(C)C1CCC(C)=CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 428.613
CB1 binding score: -14.578
InChIKey:VSEKBRGVTNAGPR-UHFFFAOYSA-N
ID: 93106
SMILES:C12C3(C(=O)OCC3CCC1)c1c(cc(CCCCC)cc1O)OC2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.424
CB1 binding score: -11.405
InChIKey:CBVANPIZLMQYHG-UHFFFAOYSA-N
ID: 93107
SMILES:C(C=C(C)C)CC(C)CCCC(=CCc1c(O)cc(C)c(O)c1)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.512
CB1 binding score: -17.334
InChIKey:RUTPKBVACOSZDU-UHFFFAOYSA-N
ID: 93108
SMILES:C(C)(C)(CC1C(O)=C(C(=O)O)c2c(CCCCC)cc(O)c3c2C1CC=C(C)C3)O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 414.542
CB1 binding score: -12.622
InChIKey:GOQQAQOROGWHOW-UHFFFAOYSA-N
ID: 93109
SMILES:C1(CC=CC(C)C)(C)Oc2c(cc(O)cc2C)C=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.361
CB1 binding score: -19.118
InChIKey:LUFAPJHKZHVTEI-UHFFFAOYSA-N
ID: 93110
SMILES:C(CCc1cc2c(c(O)c1)C1C(C(=C)C)CCC(C)(O)C12)c1cc(O)c(C2C=C(C)CCC2C(C)=C)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 528.733
CB1 binding score: -14.688
InChIKey:HKRAWOAOUDQGPG-UHFFFAOYSA-N
ID: 93111
SMILES:c1(O)cc(CCCCC)cc2c1C1C(CCC(C)=CCC(C(C)=C)C2)c1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 368.561
CB1 binding score: -13.433
InChIKey:ZZTDUDVYNSZWHT-UHFFFAOYSA-N
ID: 93112
SMILES:C12C(C)(C)Oc3c(c(O)cc(CCCCC)c3)C1C=C(C(=O)OC)C(O)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.477
CB1 binding score: -17.334
InChIKey:MWXQWXBSBFQXFG-UHFFFAOYSA-N
ID: 93113
SMILES:CC(C)C1C(c2c(O)cc(CCCCC)cc2O)C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -19.815
InChIKey:PCXRACLQFPRCBB-UHFFFAOYSA-N
ID: 93114
SMILES:C(C1(C)C23C(C)(CCC1C(C(=O)O)(C)C2)Oc1c3cc(O)c(C(=C)C)c1)OCOc1c(O)ccc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 564.719
CB1 binding score: -15.929
InChIKey:ZZIQDRAZUATGLA-UHFFFAOYSA-N