ID: 115480
SMILES:C1(C)=CC2c3c(O)cc(CCCCC)cc3OC(C)(C)C2CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 115481
SMILES:Oc1cccc(C2C(C(C)=C)CCC(C)=C2)c1CCC[N+](C)(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.52
CB1 binding score: -12.5
InChIKey:BMDQOSGDNMEBDK-UHFFFAOYSA-O
ID: 115482
SMILES:C1C(c2c(O)cc(C(C)C(O)C(CC)C)cc2OC(C)=O)OC(C)(C)C(OC(C)=O)C1C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 450.572
CB1 binding score: -16.212
InChIKey:MOSCHJVAMBQGBC-UHFFFAOYSA-N
ID: 115483
SMILES:O1C(C(O)(C)CCC=C(C)C)Cc2c(O)cc(CCCCC)cc21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -18.732
InChIKey:KEABNGNNOKLMEH-UHFFFAOYSA-N
ID: 115484
SMILES:Oc1cc(CCCCC)cc2c1C1C(C(=C)C)CCC(C)=C1CCC2(O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 368.561
CB1 binding score: -15.601
InChIKey:OKBNADUNVFRKBP-UHFFFAOYSA-N
ID: 115485
SMILES:C12C(C(=O)CC1)c1c(O)cc(CCCCC)cc1OC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.414
CB1 binding score: -17.334
InChIKey:NURGBBAOZBVVHS-UHFFFAOYSA-N
ID: 115486
SMILES:C(CCC)Cc1cc(O)c2c(c1)OC(C)(C)C1CCC(CO)CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -19.233
InChIKey:LXSFNMQURHTPIT-UHFFFAOYSA-N
ID: 115487
SMILES:C12C(C)(C)Oc3c(c(O)cc(CCCCC)c3)CC1C(C(=O)OC)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.494
CB1 binding score: -15.929
InChIKey:NCYFVMZNMQGSOK-UHFFFAOYSA-N
ID: 115488
SMILES:C12(C)CC(c3c(O)cc(C(C)(C)C)cc3O1)CC(C)(C)C21OC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.441
CB1 binding score: -15.398
InChIKey:WPTYILSGZNPECQ-UHFFFAOYSA-N
ID: 115489
SMILES:C1(C=C(C)C)(CC(O)=O)c2c(cc(CCCCC)cc2O)CCC1(O)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.494
CB1 binding score: -13.506
InChIKey:KZJGMYQQDIEIKF-UHFFFAOYSA-N
ID: 115490
SMILES:C1CCC2(C)C(C1(C)C(=O)O)Cc1c(O)cc(CCCCC)cc1O2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.467
CB1 binding score: -16.903
InChIKey:WNHQIDFQVSAQOV-UHFFFAOYSA-N
ID: 115491
SMILES:O1c2c(c(O)c(C(=O)O)c(CCCCC)c2)C2CC(C)=CCCC(C)=C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.462
CB1 binding score: -8.757
InChIKey:DVTLPELHSIGWCR-UHFFFAOYSA-N
ID: 115492
SMILES:C(c1cc(CCCCC)cc(O)c1)(=C1CC(C(C)=C)CCC1(O)C)OC
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.522
CB1 binding score: -16.611
InChIKey:FBTPXMWYQBDMDG-UHFFFAOYSA-N
ID: 115493
SMILES:c1(C(c2c(O)cc(OC)cc2)=O)c(O)c(=O)c2c(cc1CCCCC)OC(C)(C)C(OC(=O)C)CC2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 498.572
CB1 binding score: -13.946
InChIKey:JZCZWBLDKMNISU-UHFFFAOYSA-N
ID: 115494
SMILES:C(C(=C)C(CCC(=CCCC(=CCOc1cc(O)c2c(c1)OC(C)(C)C1C2CC(C)=CC1)C)O)C)=CC(C)(O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 550.78
CB1 binding score: -17.113
InChIKey:UVDSTRCLDDDAJI-UHFFFAOYSA-N
ID: 115495
SMILES:c1c(CC=C(C)C)c(O)cc2c1C1C(C(C)(C)O2)C(C(=O)O)C(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -14.542
InChIKey:CJLABSATAQXOSO-UHFFFAOYSA-N
ID: 115496
SMILES:CC1(C)Oc2c(c(O)c(C(O)=O)c(CCCCC)c2)C2C1CCC(C)=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -19.351
InChIKey:UCONUSSAWGCZMV-UHFFFAOYSA-N
ID: 115497
SMILES:C(c1c2c(cc(C)c1OC)-c1c(O)cc(CCCCC)cc1OC2(C)C)O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 370.489
CB1 binding score: -17.196
InChIKey:QXYIXSVYYFKCJM-UHFFFAOYSA-N
ID: 115498
SMILES:Oc1c(CC=C(CCC=C(C)COC2C(O)C(O)C(O)C(CO)O2)C)c(OC(=O)C)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 536.662
CB1 binding score: -15.467
InChIKey:UDAMPKKVHBVWNM-UHFFFAOYSA-N
ID: 115499
SMILES:C1C(C)=CC2c3c(O)cc(CCCCC)cc3OC(C)(C)C2C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 115500
SMILES:c1(O)c(C)cc(O)cc1C1C(C(=C)CO)CCC(C)=C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.36
CB1 binding score: -15.422
InChIKey:SBVWJFONYPZVQE-UHFFFAOYSA-N