ID: 117559
SMILES:C(=C(C)C=CC(C1(C)CC(OC(C)=O)CC1(C)C)=O)C(=O)c1c(O)cc(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 470.606
CB1 binding score: -13.955
InChIKey:FNQDCDXPKMJEPQ-UHFFFAOYSA-N
ID: 117560
SMILES:Oc1cc(O)cc(C)c1C1C=C(C)CCC1C(=C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.361
CB1 binding score: -18.798
InChIKey:KDZOUSULXZNDJH-UHFFFAOYSA-N
ID: 117561
SMILES:C1C(C(C)C)C(c2c(O)cc(CCCCC)cc2O)CC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -19.27
InChIKey:WPJGAEFIBVPIDI-UHFFFAOYSA-N
ID: 117562
SMILES:C1CC(O)C(C)(C)Oc2cc(SC3=C(O)C(CCCC(C)(O)C)(C)O3)cc(O)c12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 424.559
CB1 binding score: -14.917
InChIKey:GLTYGYOOWONLKX-UHFFFAOYSA-N
ID: 117563
SMILES:C(=CCCC(=CC(c1c(O)cc(CCCCC)cc1O)=O)C)(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -18.621
InChIKey:RYMHOYWFINVWEV-UHFFFAOYSA-N
ID: 117564
SMILES:C12C(C1CCC=C(C)C)C(OC)c1cc(CCCCC)cc(O)c1O2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -14.875
InChIKey:FPTVVAJBBYTQEE-UHFFFAOYSA-N
ID: 117565
SMILES:C(CC=C)Cc1cc(O)c(C2C=C(C)CCC2C(C)=C)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 312.453
CB1 binding score: -16.998
InChIKey:KHPJSCHUZCESPG-UHFFFAOYSA-N
ID: 117566
SMILES:C(C1(C)Oc2c(cc(OC)c(C)c2)C=C1)C=CC(=CC=CC(C)(O)C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 354.49
CB1 binding score: -15.024
InChIKey:HFFMBGIRUBTCQG-UHFFFAOYSA-N
ID: 117567
SMILES:Cc1cc(OC(=O)C)c(C2(COC(=O)C)C3OC3C(O)C(C)C2C(=CC)C)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 418.486
CB1 binding score: -14.898
InChIKey:QYTNAJVIWYAOFO-UHFFFAOYSA-N
ID: 117568
SMILES:CC1(C)Oc2cc(CCCCC)cc(O)c2C2C=C(C)CCC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 117569
SMILES:CC1CCC(C(C)=C)Oc2c(c(O)c(CCCCC)cc2OC)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -13.256
InChIKey:VIPIIKNLYKGLIE-UHFFFAOYSA-N
ID: 117570
SMILES:C1=CC(CCC=C(C)C)(C)Oc2cc(CCC)cc(O)c21
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -18.334
InChIKey:AAXZFUQLLRMVOG-UHFFFAOYSA-N
ID: 117571
SMILES:C(CCc1cc(OC)c(O)cc1)=Cc1cc(O)c(C2C=C(C)CCC2C(C)=C)c(O)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 420.549
CB1 binding score: -12.265
InChIKey:ODTGCWYQBQUBTI-UHFFFAOYSA-N
ID: 117572
SMILES:Oc1c(C(COC(=O)C)=C2CC3C(C)(C)CCCC3(C)C3C(=O)C(OC)=C(COC)C(=O)C32)c(O)cc(CCCCC)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 596.761
CB1 binding score: -12.11
InChIKey:RHXQYULHTCBWLZ-UHFFFAOYSA-N
ID: 117573
SMILES:c1(O)c(C2C(C(=C)C)CCC(C)=C2)c(O)cc(C)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.361
CB1 binding score: -18.979
InChIKey:GKVOVXWEBSQJPA-UHFFFAOYSA-N
ID: 117574
SMILES:c1(C2C=C(CCC=C(C)C)C(=O)O2)c(O)cc(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -17.854
InChIKey:ZGNBDHDIIXUCDX-UHFFFAOYSA-N
ID: 117575
SMILES:c1(O)c(C2C=C(C)C(O)CC2C(C)=C)c(O)cc(C)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.36
CB1 binding score: -20.17
InChIKey:NRZQAMSXWBSPKY-UHFFFAOYSA-N
ID: 117576
SMILES:O(C(c1cc2c(c(OC)c1)C1C=C(C)CCC1C(C)(C)O2)C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.441
CB1 binding score: -16.772
InChIKey:MOTINSQIWOGACF-UHFFFAOYSA-N
ID: 117577
SMILES:Oc1c(O)c2c(cc1CCCCC)OC(C)(C)C1CCC(C)=CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -17.996
InChIKey:XXGMIHXASFDFSM-UHFFFAOYSA-N
ID: 117578
SMILES:C(C(C)c1cc(O)c2c(c1)OC(C)(C)C1C2CCC1=O)CC
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.414
CB1 binding score: -15.248
InChIKey:KFZIGQGZASLDKT-UHFFFAOYSA-N
ID: 117579
SMILES:c1c(O)c(C2C=C(C)CCC2C(=C)C)c(O)cc1-c1occc1CCCC(C)=C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 392.539
CB1 binding score: -18.898
InChIKey:ISPUAGTYZOWCAZ-UHFFFAOYSA-N