ID: 40972
SMILES:C(CCCCCc1cc2c(c(O)c1)C1C(CCC(C)=C1)C(C)(C)O2)=C(C)C=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 380.572
CB1 binding score: -15.813
InChIKey:OWUDKTZVHGPUHG-UHFFFAOYSA-N
ID: 40973
SMILES:c1c(C)c(O)c2c(c1)C1C=C(C)CCC1C(C)(C)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.361
CB1 binding score: -18.204
InChIKey:PJFIFGWWIOJVLW-UHFFFAOYSA-N
ID: 40974
SMILES:c1(CCCCC)cc2c(c(O)c1)C1C(CC3C(C)CC4C(C(C)=C)CCC(C)(C1)C43)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 422.653
CB1 binding score: -15.929
InChIKey:QPUYUIOCIAUUQR-UHFFFAOYSA-N
ID: 40975
SMILES:C(C)(C)C(OC)c1c(C=C(C)C)c(O)c(C(=O)C(C)C)c2c1OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 454.651
CB1 binding score: -18.803
InChIKey:KZOSEFCWKAYPEO-UHFFFAOYSA-N
ID: 40976
SMILES:O1c2c(c(O)cc(CCCCC)c2)C2(C)C(C)CCC3(C)C12C(C)CCC3
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 370.577
CB1 binding score: -14.024
InChIKey:UXCIEZQRCWMBOC-UHFFFAOYSA-N
ID: 40977
SMILES:C1(C)(C)CC(=O)CC2(C)Oc3c(c(O)cc(CCC)c3)C21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.387
CB1 binding score: -15.8
InChIKey:FZZDJPHQJMOJCF-UHFFFAOYSA-N
ID: 40978
SMILES:C(CCCC)c1cc(O)c2c(c1)OC(CCC=C(C)C)(C)C(O)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -19.002
InChIKey:ITDDKOGKAGSKEJ-UHFFFAOYSA-N
ID: 40979
SMILES:O1C2(C(C)C)Oc3c(c(O)cc(CCCCC)c3)C(C1O)C(C)C2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 334.456
CB1 binding score: -14.614
InChIKey:KUABDTWHDXWQQB-UHFFFAOYSA-N
ID: 40980
SMILES:Oc1c(O)c(CCCCC)c(C2C(O)C(=O)C(C)(C)O2)cc1C(CCC=C(C)C)(C)O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 434.573
CB1 binding score: -9.52
InChIKey:FEMXIUNTACQRIE-UHFFFAOYSA-N
ID: 40981
SMILES:C(CC)CCCc1cc2c(c(O)c1)C1C(CCC(C)=C1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -19.964
InChIKey:DMJVNNFBMZZLFB-UHFFFAOYSA-N
ID: 40982
SMILES:C(CCCCc1cc2c(c(O)c1)C1C=C(C)CCC1C(C)(C)O2)CCCCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 384.604
CB1 binding score: -18.531
InChIKey:QHXOCZYXQWUAQM-UHFFFAOYSA-N
ID: 40983
SMILES:C1C(C(C)=C)C(c2c(O)cc(CCCC)cc2O)C=C(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -19.739
InChIKey:WBRXESQKGXYDOL-UHFFFAOYSA-N
ID: 40984
SMILES:C(C)CCCc1cc(O)c2c(c1)OC(C)(C)C1CC=C(C)CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.121
InChIKey:HCAWPGARWVBULJ-UHFFFAOYSA-N
ID: 40985
SMILES:C(CCc1c2c(c(C)cc1O)C(C)C(O)C(C)(C)O2)CCCCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 334.5
CB1 binding score: -15.806
InChIKey:KLXYZMOTXXAVFD-UHFFFAOYSA-N
ID: 40986
SMILES:c1(CCCCCC)cc2c(c(O)c1)C1CC(C)(CCC1C(=C)C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -17.354
InChIKey:LOTJAJIHOKJTOT-UHFFFAOYSA-N
ID: 40987
SMILES:c1(CCCCCCCCCC)c(C(=O)O)c(O)c2c(c1)OC(C)(C)C1CCC(C)=CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 428.613
CB1 binding score: -15.787
InChIKey:KSARJBARNRSARV-UHFFFAOYSA-N
ID: 40988
SMILES:C1(C)(C)c2c(cc(CCCCC)cc2O)OC1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 234.339
CB1 binding score: -17.182
InChIKey:DSUNEXXIELRDPB-UHFFFAOYSA-N
ID: 40989
SMILES:C(C)(C)=CCCC(C)=CCc1c(O)cc(C(C(OC)C(C)C)O)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 362.51
CB1 binding score: -16.015
InChIKey:BSGSPJVUIYGSKV-UHFFFAOYSA-N
ID: 40990
SMILES:C1=CC2(C(CCC=C(C)CO)C)COC1(C)Oc1cc(CCCCC)cc(O)c12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 400.559
CB1 binding score: -14.326
InChIKey:KDBMWYMTPSXUOC-UHFFFAOYSA-N
ID: 40991
SMILES:C1CC(O)C2Oc3c(c(OC)cc(CCCCC)c3)C2C1C(CCC=C(C)C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 400.603
CB1 binding score: -15.639
InChIKey:PHXHNQBSOUNMTG-UHFFFAOYSA-N
ID: 40992
SMILES:C1(C)=CC2c3c(cc(CCCCC)c(O)c3O)OC(C)(C)C2CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -17.996
InChIKey:XXGMIHXASFDFSM-UHFFFAOYSA-N