ID: 10249
SMILES:C(CCCC)c1cc(O)c2c(c1)OC(C)(C)C1CC=C(C)C(O)C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -19.186
InChIKey:KQQMZTULVOWZJR-UHFFFAOYSA-N
ID: 10250
SMILES:C1(C(CC(C)C)c2cc(C(O)C(C)C)c(O)c(C(=O)OC)c2O)OC(C)(C)C(O)C1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 424.534
CB1 binding score: -15.731
InChIKey:ZGXUAYAIGFHHEV-UHFFFAOYSA-N
ID: 10251
SMILES:C(C)(C)C(OCC1=CC2c3c(cc(CCCCC)c(C(O)=O)c3O)OC(C)(C)C2CC1)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 444.568
CB1 binding score: -15.929
InChIKey:QABHLZHSTVPMTO-UHFFFAOYSA-N
ID: 10252
SMILES:c1(O)cc(O)c2c(c1)C1C(C(C)(C)O2)CCC(C)=C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 260.333
CB1 binding score: -18.766
InChIKey:GNBSKWGIRCMMKP-UHFFFAOYSA-N
ID: 10253
SMILES:C1C2C(C)(C)C(Br)CCC2(C)Oc2c1c(O)cc(CCCCC)c2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 395.381
CB1 binding score: -17.636
InChIKey:XEXBDTKYMSGJTR-UHFFFAOYSA-N
ID: 10254
SMILES:CC(C)=CCCC1(C)Oc2c(c(O)cc(CCCCC)c2)C=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.933
InChIKey:UVOLYTDXHDXWJU-UHFFFAOYSA-N
ID: 10255
SMILES:c12c(O)c3c(cc1C(=O)OC(C)(C)C1C2C=C(C)CC1)OCC3C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.408
CB1 binding score: -12.167
InChIKey:NWZHSYCIQSXMKM-UHFFFAOYSA-N
ID: 10256
SMILES:C12(CC1)OC(=O)C(C)C2c1c(O)cc(CCCCC)cc1O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 304.386
CB1 binding score: -16.124
InChIKey:WKHRVDNWUKIWTK-UHFFFAOYSA-N
ID: 10257
SMILES:CC1(C)C2CC=C(CO)CC2c2c(O)cc(CCC)cc2O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.414
CB1 binding score: -17.797
InChIKey:KERKCYZDMNZUKU-UHFFFAOYSA-N
ID: 10258
SMILES:C12C(C=C(C)C)C(O)C(C)=CC(c3c(O)cc(CCCCC)cc3O1)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -15.837
InChIKey:YTOWQOFEZRRPEB-UHFFFAOYSA-N
ID: 10259
SMILES:C1C(C)=CCC2(O)C(C)(C)Oc3cc(CCCCC)cc(O)c3C21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -18.016
InChIKey:DYJVRFKTUHQJIG-UHFFFAOYSA-N
ID: 10260
SMILES:C1C=C(C)C2Oc3c(c(O)cc(CCCCC)c3)C2C2C(C)(CCC2(C(C)=C)O)C(=O)CC1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 466.662
CB1 binding score: -15.148
InChIKey:VRPFBRRXYFRMMV-UHFFFAOYSA-N
ID: 10261
SMILES:Oc1cc(CCCCC)cc2c1-c1c(c3c(cc1)OC(C)(C)C1C3)OC(C)(C)C1C2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 406.566
CB1 binding score: -13.723
InChIKey:PSSSYNXAPYJEMP-UHFFFAOYSA-N
ID: 10262
SMILES:COc1c2c(cc(CCCCC)c1)OC(C)(C)C1CC=C(C(=O)O)CC1C(=O)C2(C)O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 430.541
CB1 binding score: -16.26
InChIKey:RCYVIMAFOBEILG-UHFFFAOYSA-N
ID: 10263
SMILES:c1(=O)c(Oc2c(C)c(C(C)=O)c(O)c(CC=C(CCC=C(C)C)C)c2)cc(O)c2c(c1)OC(C)(C)C1CC=C(C(=O)O)CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 602.724
CB1 binding score: -15.434
InChIKey:INBQBLQCZKHINL-UHFFFAOYSA-N
ID: 10264
SMILES:C1(C)=CCC2C(C1)c1c(cc(CCc3ccccc3)cc1O)OC2(C)C
Pathway: Shikimates and Phenylpropanoids;Terpenoids
Superclass: Meroterpenoids;Stilbenoids
Class: Cannabinoids;Monomeric stilbenes
MW: 348.486
CB1 binding score: -17.817
InChIKey:AAVGZFGYDPFYEH-UHFFFAOYSA-N
ID: 10265
SMILES:C1(=C)CCC(C(=C)C)C(c2c(O)cc(C)cc2O)C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.361
CB1 binding score: -16.868
InChIKey:JGZSDZXNHSKGNP-UHFFFAOYSA-N
ID: 10266
SMILES:O1C2CC(O)c3c(c(O)cc(CCCCC)c3)C12C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 262.349
CB1 binding score: -14.885
InChIKey:TWNXZXSZCWMUBK-UHFFFAOYSA-N
ID: 10267
SMILES:C(CCC)Cc1cc2c(c(O)c1)C1C(C(C)(C)O2)CC=C(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.121
InChIKey:HCAWPGARWVBULJ-UHFFFAOYSA-N
ID: 10268
SMILES:C1(C)(C)C2(C(C)=CC(=O)C1)c1c(O)cc(CCCCCC)cc1OC2C=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 396.571
CB1 binding score: -16.404
InChIKey:XMZHGKNLPXDTTQ-UHFFFAOYSA-N
ID: 10269
SMILES:C1C2(c3c(cc(CCCCC)cc3O)O1)CC1C(C3C4(C)C1O4)(C)CCC=C3C2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 394.555
CB1 binding score: -14.084
InChIKey:PXVZSCFAKMWKLE-UHFFFAOYSA-N