ID: 53803
SMILES:COc1cc(CCC)c2c(c1)OC(CCC=C(C)C)(C)C(O)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.457
CB1 binding score: -15.963
InChIKey:QKQLEYIJANBPJP-UHFFFAOYSA-N
ID: 53804
SMILES:C1(CCC=C(C)C)=CC(c2ccc(C)cc2O)C(C)(C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 298.47
CB1 binding score: -15.656
InChIKey:ZVHZFOZBOJOVNL-UHFFFAOYSA-N
ID: 53805
SMILES:C1C(O)C(C)=CCC2C(C)(C)Oc3c(c(O)cc(CCCCC)c3)C21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -19.278
InChIKey:LPBNLDPLKUJIEG-UHFFFAOYSA-N
ID: 53806
SMILES:c12c(C)cccc1-c1c(cc(CCCCC)cc1O)OC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 310.437
CB1 binding score: -17.926
InChIKey:JUYGZFFPQIBMLX-UHFFFAOYSA-N
ID: 53807
SMILES:CCCCCCc1cc2c(cc1O)OC(C)(C)C1C2CC(C)=CCC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.523
CB1 binding score: -15.582
InChIKey:ASZVWZOENVKZDH-UHFFFAOYSA-N
ID: 53808
SMILES:c1(O)c2c(cc(CCCC(C)CO)c1)OC(C)(C)C1CC=C(C(O)=O)CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.477
CB1 binding score: -15.8
InChIKey:UWFODBRZPLHJBT-UHFFFAOYSA-N
ID: 53809
SMILES:C12C(CCC1=C)C(C)(C)Oc1cc(CCCCC)cc(O)c12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -18.729
InChIKey:VHYDABIFTJKCRR-UHFFFAOYSA-N
ID: 53810
SMILES:CC1=CCC2C1C(C)(C)Oc1c2c(O)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -16.306
InChIKey:WZGBIMOHMDEOSH-UHFFFAOYSA-N
ID: 53811
SMILES:c1(O)cc(CCCCC)cc2c1C1C(CC=C(C)C1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.121
InChIKey:HCAWPGARWVBULJ-UHFFFAOYSA-N
ID: 53812
SMILES:C1C2C(C(=O)OC)C3(OC4(c5c(cc(CCCCC)cc5OC)O1)C(=O)C4OC3=O)C2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 430.453
CB1 binding score: -15.048
InChIKey:GRFLAYXOKWTWKE-UHFFFAOYSA-N
ID: 53813
SMILES:C(CCC)CCc1cc(O)c(C2C(C(=C)C)CCC(C)=C2)c(O)c1CC1C(C)(C)CCC=C1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 464.734
CB1 binding score: -17.015
InChIKey:VZPZOWIHJBLZPC-UHFFFAOYSA-N
ID: 53814
SMILES:C(C)(=O)CCc1cc(O)c(CC=C(C)CCC=C(C)C)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Tetraketide meroterpenoids
MW: 316.441
CB1 binding score: -16.98
InChIKey:AQQGMOYUEFOKED-UHFFFAOYSA-N
ID: 53815
SMILES:O(c1cc(CCCCCC)cc(O)c1C1CC(C)(O)CCC1C(C)C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 362.554
CB1 binding score: -14.033
InChIKey:PULCTQOEQNEMMP-UHFFFAOYSA-N
ID: 53816
SMILES:c1(CCCC(=C)CO)cc2c(c(O)c1)-c1c(ccc(C)c1)C(CO)(C)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 354.446
CB1 binding score: -16.044
InChIKey:IRZGZBZXTFVHKG-UHFFFAOYSA-N
ID: 53817
SMILES:C(CCCC)c1cc2c(c(O)c1)C1C(C(C)(C)O2)CCC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 53818
SMILES:C1C23C4C(c5c(cc(CCCCC)cc5O)OC14C(C)=CC2)C=C(C)C(=O)C(C)(C)C3C(OC(C)(C)CC)=O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 534.737
CB1 binding score: -16.668
InChIKey:ZYVSMWWSAMSMRC-UHFFFAOYSA-N
ID: 53819
SMILES:C1CC(=C)C(CCC2(C)Oc3c(O)c(O)cc(CCCCC)c3)(O)C(C)=CC(=O)C2C1(OO)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 474.594
CB1 binding score: -16.401
InChIKey:CPTHJWIIMDRCHG-UHFFFAOYSA-N
ID: 53820
SMILES:C1(C)=CC(c2c(O)cc(O)cc2CCCCC)C(C(=C)C)CC1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -16.645
InChIKey:QFBGUBAPLYNEFJ-UHFFFAOYSA-N
ID: 53821
SMILES:CC(=CCCC(C)=CCCC(=CCc1c(O)cc(CCCCC)cc1-c1ccccc1O)C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 460.702
CB1 binding score: -15.132
InChIKey:RNPZHNMVGXFMPD-UHFFFAOYSA-N
ID: 53822
SMILES:CC(C)C12Oc3cc(CCCCC)cc(O)c3C1C=C(C)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -17.928
InChIKey:SMTJUGXKTVNGCI-UHFFFAOYSA-N
ID: 53823
SMILES:Oc1cc(O)c(C(=O)C(C)C)c2c1C1CC(C)=CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.424
CB1 binding score: -17.896
InChIKey:YAFMVAAAXLTYHW-UHFFFAOYSA-N