ID: 86542
SMILES:C(C)CCCc1cc2c(c(O)c1)C1C(C(=C)C)CCC(O)(C)C1O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -18.142
InChIKey:RBEAVAMWZAJWOI-UHFFFAOYSA-N
ID: 86543
SMILES:c1(OC)c(C)cc2c(c1)C(C)(C)Oc1c2c(O)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 340.463
CB1 binding score: -18.805
InChIKey:FPNAYBZLIGJJAV-UHFFFAOYSA-N
ID: 86544
SMILES:C(CCCC)c1cc(O)c(C2OC(O)(C)C(O)C2)c(O)c1CC=C(C)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 364.482
CB1 binding score: -14.955
InChIKey:GOJSZKINHBBXRL-UHFFFAOYSA-N
ID: 86545
SMILES:C(c1ccc(COC(C2CCC(C)=CC2)=C)c(O)c1)CCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -16.141
InChIKey:YWOIDVBPPUDJPO-UHFFFAOYSA-N
ID: 86546
SMILES:C1(C)=CC(c2ccc(CCCCC)cc2)C(C)(C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 270.46
CB1 binding score: -18.245
InChIKey:JABOKCHVHQNBRW-UHFFFAOYSA-N
ID: 86547
SMILES:C1C(C)=CC2C(C(C)(C)Oc3c2ccc(O)c3)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.361
CB1 binding score: -14.971
InChIKey:YPTKEHOXFPSOJQ-UHFFFAOYSA-N
ID: 86548
SMILES:C(CCCC1(C)C(Cc2cc(OC)cc(CO)c2)C(C(C)=C)CC1O)C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 388.592
CB1 binding score: -12.903
InChIKey:QYTCWMQNNMCLFV-UHFFFAOYSA-N
ID: 86549
SMILES:c12c(c(CC=C(CCC=C(C)C)C)cc(O)c1)OC(C)(C)C1C2C=C(C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 380.572
CB1 binding score: -17.154
InChIKey:PTOQHADZIOJFKL-UHFFFAOYSA-N
ID: 86550
SMILES:C(CCCC)c1cc(O)c2c(c1)OC(C)(CCC=C(C)C)C=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.933
InChIKey:UVOLYTDXHDXWJU-UHFFFAOYSA-N
ID: 86551
SMILES:c1(CC(C)C(O)=O)oc(=O)c(C2C(C(C)C)CCC(C)=C2)c(O)c1CC=C(CCC=C(C)C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 470.65
CB1 binding score: -13.991
InChIKey:WTSUNZMDMCRZNY-UHFFFAOYSA-N
ID: 86552
SMILES:C12=C(C(C)CC1)c1c(cc(CCCCC)cc1O)OC(C)(C)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -15.929
InChIKey:GGHUGXXFLVDKRB-UHFFFAOYSA-N
ID: 86553
SMILES:C(Cc1c(O)ccc2c1OC1(C(C)(C)C(C)=CCC1)C2)CCCC
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -12.371
InChIKey:GQECNHXEWXCVEE-UHFFFAOYSA-N
ID: 86554
SMILES:OCC=C(C)C1C(C=C(C)C)Oc2c1c(O)c(C(O)=O)c(CCCCC)c2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.477
CB1 binding score: -18.054
InChIKey:DOGJYNSYDNXVPY-UHFFFAOYSA-N
ID: 86555
SMILES:OC1C(C)=CC2c3c(O)cc(CC)cc3OC(CCC=C(C)C)(C)C2CC(C(=C)C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 424.625
CB1 binding score: -13.74
InChIKey:CELAUVBHPLJFID-UHFFFAOYSA-N
ID: 86556
SMILES:c1(CCCC(C)C)cc(O)cc2c1OC(C)(CCC=C(C)C)C(O)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.511
CB1 binding score: -13.42
InChIKey:ZCDATMRDUFUBDP-UHFFFAOYSA-N
ID: 86557
SMILES:Cc1c(CCCCC)cc2c(c1O)C1C(C(C)(C)O2)CCC(CO)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -14.821
InChIKey:OYRUFPVGHGHHLR-UHFFFAOYSA-N
ID: 86558
SMILES:c1(OC)c(CCC)c(O)c(C2C=C(C)CCC2C(=C)C)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.441
CB1 binding score: -18.197
InChIKey:NOGQCMZMFLTBTI-UHFFFAOYSA-N
ID: 86559
SMILES:C1(C)=CC2C(CC1)C(C)(C)Oc1cc(CCCCC)c(C(=O)Oc3ccc(O)c(I)c3)C1C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 562.488
CB1 binding score: -13.968
InChIKey:SQLBTLCDLZEEFI-UHFFFAOYSA-N
ID: 86560
SMILES:O=c1ccc(CCCC)c2c(c1)OC(C)(C)C1=C2C(O)C(O)(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -13.725
InChIKey:JHBISBYBOQJYRA-UHFFFAOYSA-N
ID: 86561
SMILES:C(C)Cc1cc(O)c(C2C(C(C)C)CCC(C)=C2)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids;Sesquiterpenoids
Class: Cadinane sesquiterpenoids;Cannabinoids
MW: 288.431
CB1 binding score: -16.605
InChIKey:MMHGREGEOCWROM-UHFFFAOYSA-N
ID: 86562
SMILES:CC(CCC(c1c(O)c(C=O)cc2c1CC(O)C(C)(C)O2)O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 322.401
CB1 binding score: -13.222
InChIKey:FEGKUGSEZJZROT-UHFFFAOYSA-N