ID: 97441
SMILES:C1=C(C)CCC2C1c1c(cc(Br)c(O)c1)OC2(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 323.23
CB1 binding score: -18.306
InChIKey:HTFNXHQGRQXUTG-UHFFFAOYSA-N
ID: 97442
SMILES:C12C(C)(Oc3c(c(OC)cc(CCCCC)c3)C1O)C(OC(=O)C)C1C(C3(CO3)C)CCC1(C)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 486.649
CB1 binding score: -14.202
InChIKey:VWHJCBSLSWXVOG-UHFFFAOYSA-N
ID: 97443
SMILES:O=C1c2c(cc(CCCCC)cc2O)OC2(C)C1C1C(C(C)C)C(OC(=O)CCC)C(OC(=O)C)C1(C)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 542.713
CB1 binding score: -12.506
InChIKey:GYNBHJWHDXMEGY-UHFFFAOYSA-N
ID: 97444
SMILES:O(CC(CC)C)c1cc2c(c(O)c1C1(C)CCC(O)C(C)(C)O1)OC(C)C(C)O2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 408.535
CB1 binding score: -16.43
InChIKey:SLTCDDUTEHGLJJ-UHFFFAOYSA-N
ID: 97445
SMILES:C(CCC)Cc1cc(O)c(CC=C(C)CCC=C(C)CCC=C(C)C)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Tetraketide meroterpenoids
MW: 384.604
CB1 binding score: -20.123
InChIKey:WYEFRBILENQYOH-UHFFFAOYSA-N
ID: 97446
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: 97447
SMILES:C1(=O)C(=Cc2c(O)c(C3C=C(C)CCC3C(C)=C)c(OC)cc2)CC(C)(C)O1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 382.5
CB1 binding score: -16.348
InChIKey:ZOZQRPDUTHNWJS-UHFFFAOYSA-N
ID: 97448
SMILES:C1(CC(C)C)c2c(cccc2)-c2c(O)c3c(c(O)c21)OC(C)(C)C1C3C=C(C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 404.55
CB1 binding score: -15.396
InChIKey:CVCHVIXCISTTJA-UHFFFAOYSA-N
ID: 97449
SMILES:C(CO)(=CC(O)c1cc(O)c2c(c1)OC(C)(C)C1CC=C(CO)CC21)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.45
CB1 binding score: -14.563
InChIKey:ZDXPRUMRORHIKJ-UHFFFAOYSA-N
ID: 97450
SMILES:CCCc1cc(OC)c(O)c(CC=C(C)CCC=C(C)C)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.458
CB1 binding score: -16.005
InChIKey:CRPFBGVFLCNYHH-UHFFFAOYSA-N
ID: 97451
SMILES:C1(C)=CCCC(C)(C)Oc2cc(CCCCC)cc(OC)c21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.458
CB1 binding score: -14.746
InChIKey:CMQGKOJGMWPMOK-UHFFFAOYSA-N
ID: 97452
SMILES:C(C=C(C=O)C)CC1(C)C(C)Oc2c1c(O)cc(CCCCC)c2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -12.503
InChIKey:RKSGDYHXPNWMHI-UHFFFAOYSA-N
ID: 97453
SMILES:C(Cc1cc(OC)c2c(c1)OC(C)(C)C1C(O)CC(=C)C(OC(=O)C)CC21)=O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 388.46
CB1 binding score: -15.662
InChIKey:BWFMNOOYJOGLIU-UHFFFAOYSA-N
ID: 97454
SMILES:C(CCC)Cc1cc2c(c(O)c1C(=O)O)CC(C)=CCCC(C)=CC2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.479
CB1 binding score: -17.986
InChIKey:CYXLSBIVHCBYAM-UHFFFAOYSA-N
ID: 97455
SMILES:C(N(C)C(C(C)c1cc(O)c(C2(C)CCCC(C)(C)O2)cc1)=O)CCCC
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 375.553
CB1 binding score: -15.184
InChIKey:GSXAQOUMHBPEAS-UHFFFAOYSA-N
ID: 97456
SMILES:C1=CC(CCC2(C)Oc3c(c(O)cc(CCCCC)c3)C=C2)(C)CCC1C(C(CCC(C)C)O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 482.749
CB1 binding score: -15.929
InChIKey:KBBOSJSBIAYREZ-UHFFFAOYSA-N
ID: 97457
SMILES:c12c(cc(CCC)cc1O)OC(C)(C)C1=CCC(CO)=CC21
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.398
CB1 binding score: -13.774
InChIKey:MWBQZTJDUPXYNA-UHFFFAOYSA-N
ID: 97458
SMILES:O(c1c2c(cc(CCCCC)c1)OC(C)(C)C1CC=C(C)C(C1)C2)C(C)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 370.533
CB1 binding score: -14.935
InChIKey:TZNCCMPJSGHJPB-UHFFFAOYSA-N
ID: 97459
SMILES:c1(O)cc(C)c2c(c1OC)C(=O)C(C)C1C2C(C)(C)OC(C=CCC(CC)C)(C)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 416.558
CB1 binding score: -15.22
InChIKey:KWOOAFCLEOBLQO-UHFFFAOYSA-N
ID: 97460
SMILES:C1(C)(C)Oc2c(c(O)cc(CCCC)c2)-c2cc3c(cc21)OC(C=C(C)C)C3
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 378.512
CB1 binding score: -13.063
InChIKey:AZACNPTUJMQSCI-UHFFFAOYSA-N
ID: 97461
SMILES:C(C)CCCc1cc(O)c2c3c1C1C(C(C)(C)O2)CCC(C)=C1CC1C3C1(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 394.599
CB1 binding score: -15.345
InChIKey:SVEUILABFZXTPM-UHFFFAOYSA-N