ID: 58024
SMILES:CC(=CCCC(C)=CCCC(=CCc1c(O)cc(CCCCC)c(O)c1)C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 384.604
CB1 binding score: -17.351
InChIKey:SQRVZRBFCFPASS-UHFFFAOYSA-N
ID: 58025
SMILES:O(CC1=CC2c3c(cc(CCCCC)cc3OC)OC(C)(C)C2CC1)C(=O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.532
CB1 binding score: -17.577
InChIKey:AHQPABPKXKUGCW-UHFFFAOYSA-N
ID: 58026
SMILES:CC(=C)C1CC=C(C)CC1c1c(O)cc(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.129
InChIKey:ZTGXAWYVTLUPDT-UHFFFAOYSA-N
ID: 58027
SMILES:C1C(Br)C(C)(C)Oc2cc(CCCCC)cc(OC)c21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 341.289
CB1 binding score: -16.765
InChIKey:LXSFCZXELIJGHT-UHFFFAOYSA-N
ID: 58028
SMILES:CCCCCc1cc2c(c(O)c1)C1CC(C)=CCC1C(CCC=C(C)C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 382.588
CB1 binding score: -18.559
InChIKey:NEOMHYIKJUAVNS-UHFFFAOYSA-N
ID: 58029
SMILES:CC1=CC2C(C(C)(C)Oc3c2c(O)cc(CCCCCO)c3)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -17.915
InChIKey:LNEDOGQBWSHVNR-UHFFFAOYSA-N
ID: 58030
SMILES:C=C(C)C1C(c2c(O)cc(CCCCC)cc2O)CC(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.129
InChIKey:ZTGXAWYVTLUPDT-UHFFFAOYSA-N
ID: 58031
SMILES:C(CCC)Cc1cc(O)c(C2C(C(C)=C)CCC(C)C2)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -18.563
InChIKey:CODIXLGYYWMJFS-UHFFFAOYSA-N
ID: 58032
SMILES:C(=C(C)CO)C1Oc2c(ccc(CCCCC)c2)C2C(=C)CCC(C(C)=C)C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 380.572
CB1 binding score: -13.01
InChIKey:AWOGHYTWWJCCCR-UHFFFAOYSA-N
ID: 58033
SMILES:CC1=CC2c3c(cc(CCCCC)cc3O)OC(C)(C)C2CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 58034
SMILES:C1C(C)=CCC(C(C)C)C1c1c(O)cc(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -19.27
InChIKey:WPJGAEFIBVPIDI-UHFFFAOYSA-N
ID: 58035
SMILES:c12c(cc(CCCCC)cc1O)OC(C)(C)C1C2CC(C)(O)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.457
CB1 binding score: -18.404
InChIKey:IBSBWOIOMTZHJY-UHFFFAOYSA-N
ID: 58036
SMILES:C1(C)(C)Oc2cc(CCCCC)cc(O)c2C2C=C(CO)CCC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -19.121
InChIKey:YCBKSSAWEUDACY-UHFFFAOYSA-N
ID: 58037
SMILES:c1(COC(CC(C)C)=O)c2cc(c(OC)c1)OC(C)(C)C1CC=C(C)CC21
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.505
CB1 binding score: -16.557
InChIKey:RLOAEPDFELRWHW-UHFFFAOYSA-N
ID: 58038
SMILES:C(CCc1cc(O)c(C2C=C(C)CCC2C(=C)C)c(O)c1)CC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.427
InChIKey:QHMBSVQNZZTUGM-UHFFFAOYSA-N
ID: 58039
SMILES:CC1(C)C(CO)C2(C(C)CC1O)Cc1c(cc(CCCCC)cc1O)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 362.51
CB1 binding score: -15.293
InChIKey:QVISKEIFQNGEBQ-UHFFFAOYSA-N
ID: 58040
SMILES:CC1CCC2C(C)(C)Oc3cc(CCCCC)cc(O)c3C2C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -20.541
InChIKey:XKRHRBJLCLXSGE-UHFFFAOYSA-N
ID: 58041
SMILES:CC1(C)C2CC=C(CO)CC2c2c(c(O)cc(CCCCC)c2)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -15.671
InChIKey:GYDAWSDIXDFZPV-UHFFFAOYSA-N
ID: 58042
SMILES:c1(OCC=CC)cc(O)c2c(c1)OC(C)(C)C1C2C=C(CO)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.424
CB1 binding score: -13.664
InChIKey:HJSUFIXMPDIUKW-UHFFFAOYSA-N
ID: 58043
SMILES:o1c(CCCCC)cc2c1C1C(C(C)(C)O2)CCC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.431
CB1 binding score: -16.496
InChIKey:YFDZZYBMGPHHKQ-UHFFFAOYSA-N
ID: 58044
SMILES:c12cc(CCCCC)cc(O)c1C(=O)c1c(c(C)c(O)cc1)OC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 354.446
CB1 binding score: -15.68
InChIKey:IBVWQXPNTVXZEU-UHFFFAOYSA-N