ID: 75895
SMILES:c1c(C=CC=O)c2c(c(O)c1)C1CC(CO)CCC1C(C)(C)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.397
CB1 binding score: -14.292
InChIKey:RUBCLDHWQMWZMI-UHFFFAOYSA-N
ID: 75896
SMILES:C(C)CCCc1cc2c(cc1O)OC(C)(C)C1=CCC3(C)C(O1)CCC(C)(O)C23
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 400.559
CB1 binding score: -14.352
InChIKey:KJCPYIPWRJQSLI-UHFFFAOYSA-N
ID: 75897
SMILES:c1(-c2cc(O)c(CC=C(C)CCCC(=C)C)c(O)c2)oc(=O)c2c(c1)OC(C)(C)C1C2C=C(C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 490.64
CB1 binding score: -13.07
InChIKey:CAIZARZITBUYBF-UHFFFAOYSA-N
ID: 75898
SMILES:CC(Cc1cc(O)c(C2C=C(C)CCC2C(C)=C)c(O)c1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -19.315
InChIKey:WTRKRGRMUBVMKA-UHFFFAOYSA-N
ID: 75899
SMILES:C1=C(C)CCC(C(C)(O)C)C1c1c(O)cc(CCC)cc1O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 304.43
CB1 binding score: -19.168
InChIKey:BMEOABJGGIYLGA-UHFFFAOYSA-N
ID: 75900
SMILES:c12c(cc(CCCCC)cc1O)OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 75901
SMILES:C1(C)=CC2C(C(C)(C)Oc3c2ccc(CC=C)c3)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 268.4
CB1 binding score: -17.63
InChIKey:NOFAJVYJFXMQDU-UHFFFAOYSA-N
ID: 75902
SMILES:Oc1c2c(cc(CCCCC)c1)OC(C)(CCC=C(C)CCC=C(C)C)C=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 382.588
CB1 binding score: -19.944
InChIKey:PXPDKUHGJIMKBA-UHFFFAOYSA-N
ID: 75903
SMILES:C12=C(Cc3c(cc(CCCCC)cc3O)OC1(C)C)C(O)C(C)C1=C2C(OC)C(CO)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 442.596
CB1 binding score: -16.611
InChIKey:AGSPHEBNCGTHCE-UHFFFAOYSA-N
ID: 75904
SMILES:c1(CCCCCC)cc2c(c(O)c1)C1C(C(C)(C)O2)CC=C(C)C1CC=C(CCC=C(C)C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 464.734
CB1 binding score: -16.316
InChIKey:NBAYPRSDLUVSCF-UHFFFAOYSA-N
ID: 75905
SMILES:C1C2(C)OC2CCC(C)=CCC2C(C)(C)Oc3c(c(O)cc(CCCCC)c3O)C2C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 428.613
CB1 binding score: -12.522
InChIKey:MJDSHYZJIRYJAD-UHFFFAOYSA-N
ID: 75906
SMILES:Oc1c2c(cc(CCCCC)c1)OC(C)(C)C1C2CC(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.121
InChIKey:HCAWPGARWVBULJ-UHFFFAOYSA-N
ID: 75907
SMILES:C1(O)C(O)C(O)C(CO)OC1OC1c2c(cc(CCCCC)cc2O)OC(C)(C(OC)=O)C1C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 484.542
CB1 binding score: -13.574
InChIKey:MZPMIECSNHQJJP-UHFFFAOYSA-N
ID: 75908
SMILES:c1(CCC)c(C(=O)O)c(O)c(CC=C(C)CCC=C(C)CCC=C(C)C)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Tetraketide meroterpenoids
MW: 400.559
CB1 binding score: -18.074
InChIKey:XJNWDFKQIJOXOC-UHFFFAOYSA-N
ID: 75909
SMILES:CC(Oc1c(C(C)(C)C)cc(O)c2c1OC(C)(CCC=C(C)C)C(O)C2)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 376.493
CB1 binding score: -15.661
InChIKey:XPXMRZGQWBYBDX-UHFFFAOYSA-N
ID: 75910
SMILES:C(C(C1=CC2(Oc3c(c(O)cc(CCCCCOC)c3)C(C(C)C)C2)CC1)C)O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 402.575
CB1 binding score: -11.986
InChIKey:AFTOLSDLOUTQLT-UHFFFAOYSA-N
ID: 75911
SMILES:c12cc(CCCCC)c(O)c(O)c1C1C(CCC(C)=C1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -17.996
InChIKey:XXGMIHXASFDFSM-UHFFFAOYSA-N
ID: 75912
SMILES:C(CCC)Cc1cc(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: 75913
SMILES:c1(CCCCC)ccc2c(c1)OC(C)(C)C1CCC(C)=CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 298.47
CB1 binding score: -18.189
InChIKey:AIOSXAOKGBOYPS-UHFFFAOYSA-N
ID: 75914
SMILES:C(CCc1cc(O)c(CC=C(C)C)c(O)c1)=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 260.377
CB1 binding score: -18.498
InChIKey:SSYFVGGKLHQDPS-UHFFFAOYSA-N
ID: 75915
SMILES:C(CCCC)c1cc(O)c(C2C(C(=C)C)CCC(C)=C2)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.427
InChIKey:QHMBSVQNZZTUGM-UHFFFAOYSA-N