ID: 51556
SMILES:O(C)C1(OC)C2C(OC1=O)c1c(O)cc(CCCCC)cc1OC2(C)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 364.438
CB1 binding score: -15.876
InChIKey:HLGHAUYSWDALHP-UHFFFAOYSA-N
ID: 51557
SMILES:C(=CCCC(C)=CCc1c(O)cc(CCCCC)c(C(=O)O)c1O)C(C)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.521
CB1 binding score: -12.888
InChIKey:LHWUXMWBVUIMCP-UHFFFAOYSA-N
ID: 51558
SMILES:C1=C(C)C(O)C2C(C(C)(C)Oc3cc(CCCCC)cc(O)c32)CC2C(C)(O2)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 400.559
CB1 binding score: -15.061
InChIKey:OXZINSYNEAGPPO-UHFFFAOYSA-N
ID: 51559
SMILES:c1c(CCCCC)cc2c(c1O)C1C(C(=C)C)CCC1(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -19.819
InChIKey:KAMBAVCQZNPQOI-UHFFFAOYSA-N
ID: 51560
SMILES:C(CC=C(C)C)C(C)=CCc1c(O)c(C(=O)O)c(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.494
CB1 binding score: -19.234
InChIKey:SEEZIOZEUUMJME-UHFFFAOYSA-N
ID: 51561
SMILES:CC(CC=CC(C)(C)O)=CCCC(C)=CCc1c(O)cc(CCc2ccc(O)cc2)cc1O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 450.619
CB1 binding score: -15.916
InChIKey:OTWLOOMPBASTAG-UHFFFAOYSA-N
ID: 51562
SMILES:C1(c2c(O)cc(CCCCC)cc2O)C=C(C)CCC1C(C)(C)O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -19.812
InChIKey:FTDORWGKHUOHKJ-UHFFFAOYSA-N
ID: 51563
SMILES:Oc1c(C2C=C(C)CC(c3cc(CCN(C)C)ccc3OC)C2C(=C)C)ccc(O)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 421.581
CB1 binding score: -15.006
InChIKey:VFNQUXGLJACBNN-UHFFFAOYSA-N
ID: 51564
SMILES:C1(C)(O)C2C3c4c(O)c(C(OC)=O)c(CCCCC)cc4OC(CCC=C(C)C)(C)C3CC1C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 470.65
CB1 binding score: -15.233
InChIKey:HQIQPVHGBRIGKT-UHFFFAOYSA-N
ID: 51565
SMILES:C(c1cc(O)c2c(c1)OC(C)(C)C1CCC(O)(C)C=C12)CC
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.414
CB1 binding score: -17.594
InChIKey:MVQCKSNKCFKCOR-UHFFFAOYSA-N
ID: 51566
SMILES:c12c(c(O)cc(CCCCC)c1)C1C(=O)C(C)(C)C3C1C(C)(CC2C)O3
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.506
CB1 binding score: -16.033
InChIKey:QAAKCFUQKRHWPW-UHFFFAOYSA-N
ID: 51567
SMILES:CC1(C)C(O)C(=O)CC2(C)Oc3c(c(O)cc(CCCC)c3)C21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.413
CB1 binding score: -13.39
InChIKey:BJPXWPPKMWELND-UHFFFAOYSA-N
ID: 51568
SMILES:C(Cc1cc2c(c(O)c1)C1CC(C)=CCC1C(C)(C)O2)=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Miscellaneous meroterpenoids
MW: 312.453
CB1 binding score: -18.585
InChIKey:HVEYNLWUTOKMJT-UHFFFAOYSA-N
ID: 51569
SMILES:C1(C)(C)C2CC=C(C)CC2c2c(cc(CCCCC)cc2O)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.121
InChIKey:HCAWPGARWVBULJ-UHFFFAOYSA-N
ID: 51570
SMILES:C1CC(C)C2=C(C(C)(C)Oc3c(c(O)cc(C)c3)C3C(C)(C)C2CC3)C1O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 370.533
CB1 binding score: -15.299
InChIKey:DFRQVFXOHWFHJP-UHFFFAOYSA-N
ID: 51571
SMILES:C(CCc1cc(O)c2c(c1)OC(C)(C)C1=C2C(=O)C(OC)=C(C)C1=O)C=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 368.429
CB1 binding score: -14.51
InChIKey:AHLCEPYUCOPYGR-UHFFFAOYSA-N
ID: 51572
SMILES:O(c1cc(CCCCC)cc2c1c1c(cc2)OC(C)(C)C2CCC(C)(O)C21)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 382.544
CB1 binding score: -18.989
InChIKey:WRHPTKUZQRSOSQ-UHFFFAOYSA-N
ID: 51573
SMILES:C(CCC(=CCc1c(O)c(C(=O)O)c(CCCCC)c(O)c1O)C)=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 376.493
CB1 binding score: -17.138
InChIKey:BZHWTNCHQIQETM-UHFFFAOYSA-N
ID: 51574
SMILES:c1(O)cc(CCCCC)cc(O)c1C=C1C(C)=CCC2C(C)(C)C1C2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 340.507
CB1 binding score: -15.64
InChIKey:NASKKIQTXQNYFS-UHFFFAOYSA-N
ID: 51575
SMILES:C(=CC(c1cc(CCCCC)c2c(c1)OC(C)(C)C1C2C=C(C)CC1)=O)CCCCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 422.653
CB1 binding score: -12.024
InChIKey:RGKDZTKIEVYIIJ-UHFFFAOYSA-N
ID: 51576
SMILES:C(C=C(C)C)CC1(C)C2CC3C1C2N3CCOc1c2c(cc(CCCCC)c1)OC(C)(C)C1=C2C(C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 517.798
CB1 binding score: -13.223
InChIKey:AJGPQJKBILPEPW-UHFFFAOYSA-N