ID: 32194
SMILES:C123COC(C(=O)C)(C(O)CC1)C2C(C(C)=C)CC1c2c(O)cc(CCCCC)cc2OC(C)(C(O)C3)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 512.687
CB1 binding score: -14.939
InChIKey:NQKYKFCSUJZZHV-UHFFFAOYSA-N
ID: 32195
SMILES:C(C(OC(C)=O)C1=CC2C(CC1)C(C)(C)Oc1cc(CCCCC)cc(O)c12)C=C(C)CCC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 508.743
CB1 binding score: -11.756
InChIKey:NAQYOFZBHUYJSF-UHFFFAOYSA-N
ID: 32196
SMILES:C1=CC2C(c3c(O)cc(CCCCC)cc31)OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 366.545
CB1 binding score: -15.62
InChIKey:XFOPQKAAGWAAPD-UHFFFAOYSA-N
ID: 32197
SMILES:c1(CCCCC)cc2c(c(O)c1)C1CC(C)(O2)CCC1=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -17.314
InChIKey:CTUPXHOEXDMXQS-UHFFFAOYSA-N
ID: 32198
SMILES:Cc1c(CCCCC)cc2c(c1O)C1C(CC=C(C)C1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -17.527
InChIKey:ADYCLARNGCYRSF-UHFFFAOYSA-N
ID: 32199
SMILES:C1(OC(c2ccccc2)=O)C(C)(C)CC2C(C)(Oc3c(c(O)cc(CCC)c3)C2O)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 438.564
CB1 binding score: -15.116
InChIKey:XKOGRCZHRQVGTM-UHFFFAOYSA-N
ID: 32200
SMILES:C1(C)(C)C2CC=C(C)CC2c2c(cc(CCCCC)cc2)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 298.47
CB1 binding score: -18.423
InChIKey:MRLLOLSGDYQJHB-UHFFFAOYSA-N
ID: 32201
SMILES:c1(CCCC)cc2c(c(O)c1)C1C=C(C(O)=O)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.424
CB1 binding score: -17.51
InChIKey:LVQZQKXEEYFSQO-UHFFFAOYSA-N
ID: 32202
SMILES:C1(O)C(=O)C2C(C)(C)Oc3cc(CCCCC)cc(O)c3C2C2C(C)(O1)CCC2=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 442.596
CB1 binding score: -12.765
InChIKey:KMFHDQRSBJYDNE-UHFFFAOYSA-N
ID: 32203
SMILES:O=C1C(CO)C(O)C2c3c(cc(CCCCC)c(C(=O)O)c3O)OC(C)(C)C2C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 406.475
CB1 binding score: -13.897
InChIKey:BMYCYLDBSUWEEC-UHFFFAOYSA-N
ID: 32204
SMILES:O1C(C)(C)C2CC3c4c(O)cc(C)cc4OC31CC=C(C)C2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.398
CB1 binding score: -13.521
InChIKey:HMBCTCVCXRKDIQ-UHFFFAOYSA-N
ID: 32205
SMILES:C1CC(C)(O)c2c(cc(CCCCC)cc2O)O1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 250.338
CB1 binding score: -16.041
InChIKey:VLSWZJFPJAZUPZ-UHFFFAOYSA-N
ID: 32206
SMILES:C1(C(=C)C)C(c2c(O)cc(CCCCC)cc2O)C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.427
InChIKey:QHMBSVQNZZTUGM-UHFFFAOYSA-N
ID: 32207
SMILES:CC1CC(=O)C(C)=CC1c1c(O)cc(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.414
CB1 binding score: -16.25
InChIKey:HRYHOMNEVQTOEJ-UHFFFAOYSA-N
ID: 32208
SMILES:OC1(C)C2C(CC3(C)Oc4c(c(O)cc(CCCCC)c4)C3(C)CC2)C(C(=C)C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 426.641
CB1 binding score: -16.845
InChIKey:RSVYGPOGVUYZST-UHFFFAOYSA-N
ID: 32209
SMILES:C(CCC)Cc1cc(O)c2c(c1)OC(C)(C)C1C2[CH]C(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 313.461
CB1 binding score: -16.645
InChIKey:IDXZGOPCCVYPKD-UHFFFAOYSA-N
ID: 32210
SMILES:c12c(cc(CCCCC)cc1)OC(C)(C)C1C2CC(C)(O)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -17.63
InChIKey:JVHZDTKSUFPVNF-UHFFFAOYSA-N
ID: 32211
SMILES:C(C)(C1C(=O)CC2(C)Oc3c(c(O)cc(CCC)c3)C2C1)(O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.413
CB1 binding score: -17.16
InChIKey:DPONIYVXFRGVQF-UHFFFAOYSA-N
ID: 32212
SMILES:c1(CCC)cc2c(c(O)c1)C1C=C(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -19.321
InChIKey:ZROLHBHDLIHEMS-UHFFFAOYSA-N
ID: 32213
SMILES:CC(=C)C1CCc2c1c(O)cc(CCCCC)c2O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 260.377
CB1 binding score: -16.243
InChIKey:KKDPHDFAXFPCNN-UHFFFAOYSA-N
ID: 32214
SMILES:C1(=O)C=C(C)CC2C1C(C)(C)Oc1c2c(O)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -18.035
InChIKey:KEAXRVVDSBXMMT-UHFFFAOYSA-N